CID 66771371

1252760-19-2

Structural Information

Molecular Formula
C10H9ClO3
SMILES
C1CC1(C(=O)O)OC2=CC=C(C=C2)Cl
InChI
InChI=1S/C10H9ClO3/c11-7-1-3-8(4-2-7)14-10(5-6-10)9(12)13/h1-4H,5-6H2,(H,12,13)
InChIKey
BVOVUSTVSOEJLN-UHFFFAOYSA-N
Compound name
1-(4-chlorophenoxy)cyclopropane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

212.02402 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.03130 138.4
[M+Na]+ 235.01324 148.9
[M-H]- 211.01674 145.1
[M+NH4]+ 230.05784 154.4
[M+K]+ 250.98718 145.5
[M+H-H2O]+ 195.02128 134.2
[M+HCOO]- 257.02222 156.9
[M+CH3COO]- 271.03787 184.1
[M+Na-2H]- 232.99869 145.1
[M]+ 212.02347 143.7
[M]- 212.02457 143.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe